A1CP8
Summary
| Name: | N-[4-(trifluoromethoxy)phenyl]urea |
| Formula: | C8 H7 F3 N2 O2 |
| Formal charge: | 0 |
| Formula weight: | 220.149 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 14.52 | N-[4-(trifluoromethoxy)phenyl]urea |
| OpenEye OEToolkits | 3.1.0.0 | 1-[4-(trifluoromethyloxy)phenyl]urea |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | FC(F)(F)Oc1ccc(cc1)NC(N)=O |
| InChI | InChI | 1.06 | InChI=1S/C8H7F3N2O2/c9-8(10,11)15-6-3-1-5(2-4-6)13-7(12)14/h1-4H,(H3,12,13,14) |
| InChIKey | InChI | 1.06 | LOSFVIMHTOMZKT-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NC(=O)Nc1ccc(OC(F)(F)F)cc1 |
| SMILES | CACTVS | 3.385 | NC(=O)Nc1ccc(OC(F)(F)F)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | c1cc(ccc1NC(=O)N)OC(F)(F)F |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | c1cc(ccc1NC(=O)N)OC(F)(F)F |
